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- PDB-1lpv: DROSOPHILA MELANOGASTER DOUBLESEX (DSX), NMR, 18 STRUCTURES -

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Basic information

Entry
Database: PDB / ID: 1lpv
TitleDROSOPHILA MELANOGASTER DOUBLESEX (DSX), NMR, 18 STRUCTURES
ComponentsDoublesex protein
KeywordsTRANSCRIPTION / DROSOPHILA MELANOGASTER / DNA BINDING / GENE REGULATION
Function / homology
Function and homology information


imaginal disc-derived male genitalia development / male analia development / female analia development / female sex differentiation / sex-specific pigmentation / female somatic sex determination / imaginal disc-derived female genitalia development / sex comb development / somatic sex determination / negative regulation of developmental pigmentation ...imaginal disc-derived male genitalia development / male analia development / female analia development / female sex differentiation / sex-specific pigmentation / female somatic sex determination / imaginal disc-derived female genitalia development / sex comb development / somatic sex determination / negative regulation of developmental pigmentation / genital disc development / male sex differentiation / courtship behavior / male courtship behavior, veined wing generated song production / male courtship behavior / sex determination / sex differentiation / axon midline choice point recognition / RNA polymerase II transcription regulatory region sequence-specific DNA binding / DNA-binding transcription repressor activity, RNA polymerase II-specific / DNA-binding transcription activator activity, RNA polymerase II-specific / DNA-binding transcription factor activity, RNA polymerase II-specific / RNA polymerase II cis-regulatory region sequence-specific DNA binding / negative regulation of DNA-templated transcription / regulation of transcription by RNA polymerase II / positive regulation of DNA-templated transcription / protein homodimerization activity / positive regulation of transcription by RNA polymerase II / zinc ion binding / nucleus
Similarity search - Function
cysteine-rich DNA binding domain (DM domain) / DM DNA-binding domain / Doublesex dimerisation / Doublesex dimerisation domain / Doublesex dimerisation domain / DM DNA-binding domain / DMRT family / DM DNA-binding domain superfamily / DM DNA binding domain / DM DNA-binding domain signature. ...cysteine-rich DNA binding domain (DM domain) / DM DNA-binding domain / Doublesex dimerisation / Doublesex dimerisation domain / Doublesex dimerisation domain / DM DNA-binding domain / DMRT family / DM DNA-binding domain superfamily / DM DNA binding domain / DM DNA-binding domain signature. / DM DNA-binding domain profile. / Doublesex DNA-binding motif / Few Secondary Structures / Irregular
Similarity search - Domain/homology
MethodSOLUTION NMR / DISTANCE GEOMETRY, SIMULATED ANNEALING
AuthorsZhu, L. / Wilken, J. / Phillips, N. / Narendra, U. / Chan, G. / Stratton, S. / Kent, S. / Weiss, M.A.
Citation
Journal: Genes Dev. / Year: 2000
Title: Sexual dimorphism in diverse metazoans is regulated by a novel class of intertwined zinc fingers.
Authors: Zhu, L. / Wilken, J. / Phillips, N.B. / Narendra, U. / Chan, G. / Stratton, S.M. / Kent, S.B. / Weiss, M.A.
#1: Journal: Embo J. / Year: 1993
Title: The Drosophila Doublesex Proteins Share a Novel Zin Finger Related DNA-Binding Domain
Authors: Erdman, S.E. / Burtis, K.C.
#2: Journal: Nature / Year: 1998
Title: Evidence for Evolutionary Conservation of Sex-Determining Genes
Authors: Raymond, C.S. / Shamu, C.E. / Shen, M.M. / Seifert, K.J. / Hirsch, B. / Hodgkin, J. / Zarkower, D.
History
DepositionMay 8, 2002Deposition site: RCSB / Processing site: RCSB
Revision 1.0Oct 2, 2002Provider: repository / Type: Initial release
Revision 1.1Apr 28, 2008Group: Version format compliance
Revision 1.2Jul 13, 2011Group: Version format compliance
Revision 1.3Feb 23, 2022Group: Database references / Derived calculations
Category: database_2 / pdbx_struct_assembly ...database_2 / pdbx_struct_assembly / pdbx_struct_conn_angle / pdbx_struct_oper_list / struct_conn / struct_site
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _pdbx_struct_conn_angle.ptnr1_auth_comp_id / _pdbx_struct_conn_angle.ptnr1_auth_seq_id / _pdbx_struct_conn_angle.ptnr1_label_atom_id / _pdbx_struct_conn_angle.ptnr1_label_comp_id / _pdbx_struct_conn_angle.ptnr1_label_seq_id / _pdbx_struct_conn_angle.ptnr2_auth_seq_id / _pdbx_struct_conn_angle.ptnr2_label_asym_id / _pdbx_struct_conn_angle.ptnr3_auth_comp_id / _pdbx_struct_conn_angle.ptnr3_auth_seq_id / _pdbx_struct_conn_angle.ptnr3_label_atom_id / _pdbx_struct_conn_angle.ptnr3_label_comp_id / _pdbx_struct_conn_angle.ptnr3_label_seq_id / _pdbx_struct_conn_angle.value / _struct_conn.pdbx_dist_value / _struct_conn.ptnr1_auth_comp_id / _struct_conn.ptnr1_auth_seq_id / _struct_conn.ptnr1_label_asym_id / _struct_conn.ptnr1_label_atom_id / _struct_conn.ptnr1_label_comp_id / _struct_conn.ptnr1_label_seq_id / _struct_conn.ptnr2_auth_comp_id / _struct_conn.ptnr2_auth_seq_id / _struct_conn.ptnr2_label_asym_id / _struct_conn.ptnr2_label_atom_id / _struct_conn.ptnr2_label_comp_id / _struct_conn.ptnr2_label_seq_id / _struct_site.pdbx_auth_asym_id / _struct_site.pdbx_auth_comp_id / _struct_site.pdbx_auth_seq_id

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Assembly

Deposited unit
A: Doublesex protein
hetero molecules


Theoretical massNumber of molelcules
Total (without water)6,2563
Polymers6,1251
Non-polymers1312
Water0
1


  • Idetical with deposited unit
  • defined by author
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
NMR ensembles
DataCriteria
Number of conformers (submitted / calculated)18 / 40structures with the lowest energy
Representative

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Components

#1: Protein Doublesex protein


Mass: 6125.327 Da / Num. of mol.: 1 / Source method: obtained synthetically
Details: The sequence naturally occurs in Drosophila melanogaster (Fruit fly).
References: UniProt: P23023
#2: Chemical ChemComp-ZN / ZINC ION


Mass: 65.409 Da / Num. of mol.: 2 / Source method: obtained synthetically / Formula: Zn

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Experimental details

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Experiment

ExperimentMethod: SOLUTION NMR
NMR experiment
Conditions-IDExperiment-IDSolution-IDType
1112D TOCSY
121NOESY
131COSY
NMR detailsText: NMR EXPERIMENTS WERE CONDUCTED ON VARIAN INOVA 600 MHZ SPECTROMETERS. SOFTWARE VNMR5.1 AND FELIX WERE USED TO PROCESS NMR DATA. STRUCTURE DETERMINATION WAS PERFORMED ON A SILICON GRAPHICS WORK ...Text: NMR EXPERIMENTS WERE CONDUCTED ON VARIAN INOVA 600 MHZ SPECTROMETERS. SOFTWARE VNMR5.1 AND FELIX WERE USED TO PROCESS NMR DATA. STRUCTURE DETERMINATION WAS PERFORMED ON A SILICON GRAPHICS WORK STATION. IN 50 MM DEUTERATED TRIS, 10 MM DEUTERATED DTT.

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Sample preparation

Sample conditionspH: 6.5 / Temperature: 298 K
Crystal grow
*PLUS
Method: other / Details: NMR

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NMR measurement

NMR spectrometerType: Varian INOVA / Manufacturer: Varian / Model: INOVA / Field strength: 600 MHz

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Processing

NMR software
NameVersionDeveloperClassification
X-PLORBRUNGERrefinement
VNMR5.1structure solution
RefinementMethod: DISTANCE GEOMETRY, SIMULATED ANNEALING / Software ordinal: 1
Details: MOLECULAR MODELS WERE OBTAINED BY DGII IMPLEMENTED IN INSIGHT II (BIOSYM INC., SAN DIEGO, CA), FOLLOWED BY REFINEMENT WITH SIMULATED ANNEALING IN X-PLOR (T.F.HAVEL, A.T.BRUNGER). RESIDUE 1 ...Details: MOLECULAR MODELS WERE OBTAINED BY DGII IMPLEMENTED IN INSIGHT II (BIOSYM INC., SAN DIEGO, CA), FOLLOWED BY REFINEMENT WITH SIMULATED ANNEALING IN X-PLOR (T.F.HAVEL, A.T.BRUNGER). RESIDUE 1 IN RESTRAINTS CORRESPONDS TO RESIDUE 35 IN DSX. TWO ZINC BINDING SITES ARE: C44,C47,H59,C63 AND H50,C68 C70, C73 EACH IN A TETRAHEDRAL PATTERN. (i.e., 10,13,25,29 and 16,34,36,39 in the coordinates). RESIDUE 35-40 AND 82-105 IN DEX ARE DISORDERED. Structures are giving for residues 35 to 86, corresponding to 1 to 52 numbered in the coordinates. NO MINOR CONFORMERS WERE DETECTED.
NMR ensembleConformer selection criteria: structures with the lowest energy
Conformers calculated total number: 40 / Conformers submitted total number: 18

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